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The DNA gyrase B ATP binding domain of pseudomonas aeruginosa in complex with compound 12O

Analyse The DNA gyrase B ATP binding domain of pseudomonas aeruginosa in complex with… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6M1S
Type
protein
Length
384 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
Q9I7C2
Ligands
EZ9, CL, SO4

Structure

x-ray diffraction · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein187—Q9I7C2
B—protein197—Q9I7C2

Ligands and binding sites

  • EZ9 · 3-[5-[8-(ethylamino)-6-fluoranyl-4-[3-(trifluoromethyl)pyrazol-1-yl]-9H-pyrido[2,3-b]indol-3-yl]pyrimidin-2-yl]oxy-2,2-dimethyl-propanoic acid · ligand · 2 copies · chains A, B
  • CL · Chloride ion · ion · 3 copies · chains B
  • SO4 · Sulfate ion · ion · chains A

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Compared structures

  • 6M1S · The DNA Gyrase B ATP binding domain of PSEUDOMONAS AERUGINOSA in complex with compound 12o · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9I7C2 · AlphaFold monomer V2.0 prediction for DNA gyrase subunit B (Q9I7C2) · a predicted model of the same protein · chain A against A, TM-score 0.98

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